Identifier Cleaner
Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.
Example: aspirin
→ CC(=O)Oc1ccccc1C(=O)O
COCc1c(/N=C(/S)OC)[nH]cc2nc3ccc(OCc4ccccc4)cc3c1-2
InChI=1S/C22H21N3O3S/c1-26-13-17-20-16-10-15(28-12-14-6-4-3-5-7-14)8-9-18(16)24-19(20)11-23-21(17)25-22(29)27-2/h3-11,23H,12-13H2,1-2H3,(H,25,29)
SWTVADPQMYYHLO-UHFFFAOYSA-N
407.5